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Allylthiourea

UUID 93af2f47-4835-47ab-ad40-210674ea7a5c
Deprecated yes
Replaced By c00e8da5-ae53-4663-8e9a-2f97eded5789
Flow Object IDfo-c83ea69baf3c3f5f
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 109-57-9
EC Numbers 203-683-5
prefLabel ⓘ
Language Value Provenance
en Allylthiourea
altLabel ⓘ
Language Value Provenance
en (2-Propenyl)thiourea
en 1-Allyl-2-thiourea
en 1-prop-2-en-1-ylthiourea
en (Prop-2-en-1-yl)thiourea
en 1-Allylthiourea
en 2-Propenylthiourea
en <em>N</em>-2-Propen-1-ylthiourea
en <em>N</em>-Allylthiourea
en Allylthiocarbamide
en Aminosin
en NSC 1915
en Rhodallin
en Rhodalline
en Thiosinamin
en Thiosinamine
en Thiourea, 2-propenyl-
en Thiourea, <em>N</em>-2-propen-1-yl-
en U 19571
en Urea, 1-allyl-2-thio-
Definitions
Language Value Provenance
en A thiourea with a prop-2-enyl group attached to one of the amines.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey HTKFORQRBXIQHD-UHFFFAOYSA-N
InChI InChI=1S/C4H8N2S/c1-2-3-6-4(5)7/h2H,1,3H2,(H3,5,6,7)
IUPAC name 1-prop-2-enylthiourea, allylthiourea, prop-2-enylthiourea
Molecular formula C4H8N2S
Molecular mass 116.189
Monoisotopic mass 116.04082
SMILES C=CCNC(=S)N, C=CCNC(N)=S

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 93af2f47-4835-47ab-ad40-210674ea7a5c tiosinamine

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=tiosinamine||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=109-57-9; added Common Chemistry CAS names as altLabel: (Prop-2-en-1-yl)thiourea, 1-Allylthiourea, 2-Propenylthiourea, <em>N</em>-2-Propen-1-ylthiourea, <em>N</em>-Allylthiourea, Allylthiocarbamide, Aminosin, NSC 1915, Rhodallin, Rhodalline, Thiosinamin, Thiosinamine, Thiourea, 2-propenyl-, Thiourea, <em>N</em>-2-propen-1-yl-, U 19571, Urea, 1-allyl-2-thio-; object_uuid=fo-c83ea69baf3c3f5f
cas_match_labels 1 — consensus_match group_key=tiosinamine||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'109-57-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c83ea69baf3c3f5f: {'109-57-9': 'exactMatch'}
prefLabel 1 — consensus_match cas=109-57-9; cc_chebi_agreed_name='Allylthiourea'; object_uuid=fo-c83ea69baf3c3f5f

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Tiosinamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Allylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=109-57-9; cc_chebi_agreed_name='Allylthiourea'; object_uuid=fo-c83ea69baf3c3f5f
altLabel [{'@value': '(2-Propenyl)thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(2-Propenyl)thiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Allyl-2-thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-Allyl-2-thiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-prop-2-en-1-ylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-prop-2-en-1-ylthiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '(2-Propenyl)thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(2-Propenyl)thiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Allyl-2-thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-Allyl-2-thiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-prop-2-en-1-ylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-prop-2-en-1-ylthiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Tiosinamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=109-57-9; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-c83ea69baf3c3f5f
altLabel [{'@value': '(2-Propenyl)thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(2-Propenyl)thiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Allyl-2-thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-Allyl-2-thiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-prop-2-en-1-ylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-prop-2-en-1-ylthiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Tiosinamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': '(2-Propenyl)thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(2-Propenyl)thiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Allyl-2-thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-Allyl-2-thiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-prop-2-en-1-ylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-prop-2-en-1-ylthiourea', 'http://purl.obolibrary.org/obo/CHEBI_74079', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(Prop-2-en-1-yl)thiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-Allylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Propenylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>-2-Propen-1-ylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>-Allylthiourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Allylthiocarbamide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Aminosin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 1915', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Rhodallin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Rhodalline', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Thiosinamin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Thiosinamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Thiourea, 2-propenyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Thiourea, <em>N</em>-2-propen-1-yl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'U 19571', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Urea, 1-allyl-2-thio-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:109-57-9', 'https://commonchemistry.cas.org/detail?cas_rn=109-57-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=tiosinamine||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=109-57-9; added Common Chemistry CAS names as altLabel: (Prop-2-en-1-yl)thiourea, 1-Allylthiourea, 2-Propenylthiourea, <em>N</em>-2-Propen-1-ylthiourea, <em>N</em>-Allylthiourea, Allylthiocarbamide, Aminosin, NSC 1915, Rhodallin, Rhodalline, Thiosinamin, Thiosinamine, Thiourea, 2-propenyl-, Thiourea, <em>N</em>-2-propen-1-yl-, U 19571, Urea, 1-allyl-2-thio-; object_uuid=fo-c83ea69baf3c3f5f
cas_match_labels None {'109-57-9': 'exactMatch'} group_key=tiosinamine||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'109-57-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c83ea69baf3c3f5f: {'109-57-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "93af2f47-4835-47ab-ad40-210674ea7a5c",
  "name": null,
  "cas_numbers": [
    "109-57-9"
  ],
  "ec_numbers": [
    "203-683-5"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "93af2f47-4835-47ab-ad40-210674ea7a5c",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
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      "list_version": "3.1",
      "source_flow_uuid": "93af2f47-4835-47ab-ad40-210674ea7a5c",
      "source_flow_name": "tiosinamine",
      "source_metadata": {
        "input_file": "/home/cmutel/.local/share/consensus-flow-list/ef-31-flows.json",
        "input_dataset": "EF 3.1",
        "original_context": [
          "Emissions",
          "Emissions to water",
          "Emissions to water, unspecified (long-term)"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "Allylthiourea",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:109-57-9"
        ],
        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
      }
    }
  ],
  "_sources": {
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    "name": "bootstrap_labels",
    "synonyms": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "properties": "enrich_references",
    "skos:definition": "enrich_references",
    "references": "enrich_references",
    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C4H8N2S"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": [
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    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
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      "rdfs:label": "SMILES",
      "provenance": [
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    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
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      ],
      "rdfs:label": "InChI",
      "provenance": [
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    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
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      ],
      "rdfs:label": "InChIKey",
      "provenance": [
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        {
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    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "@value": [
        "116.189"
      ],
      "rdfs:label": "Molecular mass",
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi.basic_property_values.mass"
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "@value": [
        "116.04082"
      ],
      "rdfs:label": "Monoisotopic mass",
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi.basic_property_values.monoisotopic_mass"
      }
    },
    "https://w3id.org/chemrof/formal_charge": {
      "@id": "https://w3id.org/chemrof/formal_charge",
      "@value": [
        "0"
      ],
      "rdfs:label": "Formal charge",
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/NUM",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_semantic",
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        ],
        "prov:wasDerivedFrom": "chebi.basic_property_values.charge"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "1-prop-2-enylthiourea",
        "allylthiourea",
        "prop-2-enylthiourea"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "skos:definition": [
    {
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